SCHEMBL494705

SCHEMBL494705

CCC(CCCCCCCCCCCC(=O)OCCCC(C)C)CCC(=O)OCCCC(C)C

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.50
TSHR P16473 1/20 0.50
ATM Q13315 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
DGKA P23743 1/20 0.46
MAPT P10636 1/20 0.41
LMNA P02545 3/20 0.40
ALDH1A1 P00352 2/20 0.40
DNM1 Q05193 1/20 0.40
CA2 P00918 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
PRSS1 P07477 1/20 0.38
PRSS2 P07478 1/20 0.38
PRSS3 P35030 1/20 0.38
PLA2G2A P14555 2/20 0.36
KMT2A Q03164 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL495481 1.00 CYP3A4 (0.50) CYP3A4TSHRATMTDP1DGKA
SCHEMBL494761 1.00 CYP3A4 (0.50) CYP3A4TSHRATMTDP1DGKA
SCHEMBL494322 1.00 CYP3A4 (0.50) CYP3A4TSHRATMTDP1DGKA
SCHEMBL495762 1.00 CYP3A4 (0.50) CYP3A4TSHRATMTDP1DGKA
SCHEMBL494096 1.00 CYP3A4 (0.50) CYP3A4TSHRATMTDP1DGKA
SCHEMBL494513 1.00 CYP3A4 (0.50) CYP3A4TSHRATMTDP1DGKA
SCHEMBL495006 1.00 CYP3A4 (0.50) CYP3A4TSHRATMTDP1DGKA
SCHEMBL494295 1.00 CYP3A4 (0.50) CYP3A4TSHRATMTDP1DGKA
SCHEMBL494345 0.97 CYP3A4 (0.50) CYP3A4TSHRATMTDP1DGKA
SCHEMBL495699 0.97 CYP3A4 (0.50) CYP3A4TSHRATMTDP1DGKA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2013042797-A1 PROCESS FOR PRODUCING SOLID CATALYST COMPONENT FOR OLEFIN POLYMERIZATION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-03-28 WO disclosed
US-20130072648-A1 SOLID CATALYST FOR OLEFIN POLYMERIZATION AND PROCESS FOR PRODUCING OLEFIN POLYMER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-03-21 US disclosed
US-8105970-B2 Olefin polymerization catalyst component and production process thereof, and production proces of olefin polymerization catalyst and olefin polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-01-31 US disclosed
US-20110245439-A1 OLEFIN POLYMERIZATION CATALYST COMPONENT AND PRODUCTION PROCESS THEREOF, AND PRODUCTION PROCES OF OLEFIN POLYMERIZATION CATALYST AND OLEFIN POLYMER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-10-06 US disclosed